3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]-6-bromo-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]-6-bromo-8-methoxy-2H-1-benzopyran-2-one
3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]-6-bromo-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0424 |
| Compound Name: | 3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]-6-bromo-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 406.15 |
| Molecular Formula: | C14 H8 Br N5 O5 |
| Smiles: | COc1cc(cc2C=C(C(=O)Oc12)c1nc(c2c(N)non2)no1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7944 |
| logD: | 2.7944 |
| logSw: | -3.3264 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.965 |
| InChI Key: | RHCYZJLTZRIXAP-UHFFFAOYSA-N |